2-Chloro-6-(trifluoromethoxy)phenylboronic acid - CAS 2036084-49-6
Catalog: |
BB055618 |
Product Name: |
2-Chloro-6-(trifluoromethoxy)phenylboronic acid |
CAS: |
2036084-49-6 |
Synonyms: |
2-CHLORO-6-(TRIFLUOROMETHOXY)PHENYLBORONIC ACID; (2-Chloro-6-(trifluoromethoxy)phenyl)boronic acid; [2-chloro-6-(trifluoromethoxy)phenyl]boronic acid; (2-Chloro-6-(trifluoromethoxy)phenyl)boronicacid |
IUPAC Name: | [2-chloro-6-(trifluoromethoxy)phenyl]boronic acid |
Description: | 2-Chloro-6-(trifluoromethoxy)phenylboronic acid |
Molecular Weight: | 240.37 |
Molecular Formula: | C7H5BClF3O3 |
Canonical SMILES: | B(C1=C(C=CC=C1Cl)OC(F)(F)F)(O)O |
InChI: | InChI=1S/C7H5BClF3O3/c9-4-2-1-3-5(6(4)8(13)14)15-7(10,11)12/h1-3,13-14H |
InChI Key: | WUZKMKCNEQHESS-UHFFFAOYSA-N |
Complexity: | 214 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 239.9972364 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 6 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 239.9972364 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 49.7Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
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